Vildagliptin Impurity 3 Trifluoroacetate

Datasheet MSDS
Catalog Number
RP0059
Product Name
Vildagliptin Impurity 3 Trifluoroacetate
Structure
Vildagliptin Impurity 3 Trifluoroacetate
CAS Number
565453-41-0
IUPAC Name
(2S)-1-[2-[(3-hydroxy-1-adamantyl)amino]acetyl]pyrrolidine-2-carboxylic acid;2,2,2-trifluoroacetic acid
Synonyms
Vildagliptin Carboxy Acid Metabolite Trifluoroacetate
Molecular Formula
C17H26N2O4·C2HF3O2
Molecular Weight
436.43
Description
An impurity of Vildagliptin. Vildagliptin is a new dipeptidyl peptidase-4 (DPP-4) inhibitor that is used as an anti-hyperglycemic agent. Vildagliptin could reduce hyperglycemia in type 2 diabetes mellitus via the suppressive effect of inactivation of GLP-1 and GIP by DPP-4.
SMILES
C1CC(N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O)C(=O)O.C(=O)(C(F)(F)F)O
InChI
InChI=1S/C17H26N2O4.C2HF3O2/c20-14(19-3-1-2-13(19)15(21)22)9-18-16-5-11-4-12(6-16)8-17(23,7-11)10-16;3-2(4,5)1(6)7/h11-13,18,23H,1-10H2,(H,21,22);(H,6,7)/t11?,12?,13-,16?,17?;/m0./s1
InChI Key
ZYSYESQESYWANO-CSDSSYKASA-N
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